N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[(E)-[4-(diethylamino)phenyl]methyleneamino]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[(E)-[4-(diethylamino)phenyl]methylideneamino]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[(E)-[4-(diethylamino)benzylidene]amino]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C=NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)/C=N/NC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C21H23N5O2/c1-4-26(5-2)16-12-10-15(11-13-16)14-22-23-20(27)19-17-8-6-7-9-18(17)21(28)25(3)24-19/h6-14H,4-5H2,1-3H3,(H,23,27)/b22-14+